| Miscellaneous |
| Version lineage of this tool (guids ordered most recent to oldest) |
| toolshed.g2.bx.psu.edu/repos/chemteam/mdanalysis_dihedral/mdanalysis_dihedral/1.0.0+galaxy0 |
| toolshed.g2.bx.psu.edu/repos/chemteam/mdanalysis_dihedral/mdanalysis_dihedral/0.20 (this tool) |
| toolshed.g2.bx.psu.edu/repos/chemteam/mdanalysis_dihedral/mdanalysis_dihedral/0.19 |
| toolshed.g2.bx.psu.edu/repos/chemteam/mdanalysis_dihedral/mdanalysis_dihedral/0.18 |
| mdanalysis_dihedral |
| Requirements (dependencies defined in the <requirements> tag set) |
| name | version | type |
| mdanalysis | 0.20.1 | package |
| Functional tests |
| name | inputs | outputs | required files |
| Test-1 |
name1: OE2 resid2: 3 segid2: HET strin: test.pdb segid1: PRO segid4: HET trajin: test.dcd resid4: 3 name4: C3 resid1: 212 name3: C2 resid3: 3 segid3: HET name2: C1 |
attributes: name |
test.dcd test.pdb name |
| Test-2 |
name1: OE2 resid2: 3 segid2: SYSTEM strin: test.gro segid1: SYSTEM segid4: SYSTEM trajin: test.xtc resid4: 3 name4: C3 resid1: 212 name3: C2 resid3: 3 segid3: SYSTEM name2: C1 |
attributes: name |
test.xtc test.gro name |